[40991] trunk/dports/science/gromacs/Portfile

Ryan Schmidt ryandesign at macports.org
Mon Oct 20 13:46:16 PDT 2008


On Oct 20, 2008, at 09:59, macsforever2000 at macports.org wrote:

> Revision: 40991
>           http://trac.macports.org/changeset/40991
> Author:   macsforever2000 at macports.org
> Date:     2008-10-20 07:59:51 -0700 (Mon, 20 Oct 2008)
> Log Message:
> -----------
> Updated to version 4.0. Added double and mpi variants.  
> mac.com:mlund is now maintainer. (#15947)
>
> Modified Paths:
> --------------
>     trunk/dports/science/gromacs/Portfile
>
> Modified: trunk/dports/science/gromacs/Portfile
> ===================================================================
> --- trunk/dports/science/gromacs/Portfile	2008-10-20 12:34:10 UTC  
> (rev 40990)
> +++ trunk/dports/science/gromacs/Portfile	2008-10-20 14:59:51 UTC  
> (rev 40991)
> @@ -2,9 +2,9 @@
>
>  PortSystem 1.0
>  name		gromacs
> -version		3.3.1
> +version		4.0
>  categories	science math
> -maintainers	nomaintainer
> +maintainers	mac.com:mlund
>  description	The World's fastest Molecular Dynamics package
>  long_description	GROMACS is a versatile package to perform  
> molecular \
>  	dynamics, i.e. simulate the Newtonian equations of motion for \
> @@ -17,12 +17,29 @@
>  platforms	darwin
>
>  homepage	http://www.gromacs.org/
> -master_sites	ftp://ftp.gromacs.org/pub/${name}
> +master_sites	ftp://ftp.gromacs.org/pub/${name} \
> +                http://cluster.earlham.edu/detail/home/charliep/ 
> packages

cluster.earlham.edu doesn't seem to have gromacs-4.0.tar.gz. Do you  
know that it will be added there soon?


> -checksums	md5 1af34a99950813ca7cf893253c447cd1
> +checksums       md5 bfc18a2ecc998f542438316b9148b7ff \
> +                sha1 5c8f0c3bfa2950bb936b4bfc5e9241028ffb8f1d \
> +                rmd160 3156220f6b98ec4c04c264c8f798c616ce668a07
>
> -depends_lib 	port:fftw-3-single
> +depends_lib 	port:fftw-3-single port:openmotif
>
> -configure.args	--exec-prefix=${prefix}/lib/${name}	\
> -		--mandir=${prefix}/share/man
> +configure.args  --bindir=${prefix}/lib/${name}/bin --with-x
>
> +variant nox description {Disable X11/Motif GUI} {
> +  depends_lib-delete       port:openmotif
> +  configure.args-delete    --with-x
> +  configure.args-append    --without-x
> +}
> +variant double description {Double precision floating-point  
> arithmetics} {
> +  depends_lib-delete       port:fftw-3-single
> +  depends_lib-append       port:fftw-3
> +  configure.args-append    --enable-double
> +}
> +platform darwin powerpc {
> +  build_lib-append         port:gcc42

Syntax error. :-) Fixed:

http://trac.macports.org/changeset/41003

> +  configure.compiler       macports-gcc-4.2
> +}




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